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CS-W001157 4
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6-Methoxypyrimidin-4(3H)-one

  • CAS No. 6128-06-9

  • Cat. No. CS-0045615
  • Molecule weight126.11
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

6-Methoxypyrimidin-4(3H)-one|CS-0045615

Structure of 6128-06-9

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General Information

  • CAS No. 6128-06-9
  • Cat. No. CS-0045615
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₆N₂O₂
  • Molecular Weight 126.11
  • Synonym(s) 4-Methoxy-6-hydroxypyrimidine
  • SMILES O=C1NC=NC(OC)=C1

Description

6-Methoxypyrimidin-4(3H)-one features a pyrimidinone core with a methoxy group at the 6-position, conferring enhanced solubility and metabolic stability. This electron-deficient heterocycle serves as a key scaffold in medicinal chemistry, enabling direct incorporation into bioactive molecules through modular derivatization.

Application

6-Methoxypyrimidin-4(3H)-one serves as a versatile building block in medicinal chemistry, enabling efficient access to pyrimidine-based scaffolds through straightforward functionalization at the C2 and C5 positions. Its stability under standard reaction conditions and compatibility with diverse coupling protocols facilitate rapid derivatization. The molecule functions effectively as a synthetically accessible precursor for heterocyclic systems relevant to agrochemical and pharmaceutical development, particularly where methoxy-substituted pyrimidines are required.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   54.98
  • LogP   -0.2215
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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